O1-tert-butyl O2-methyl 4-[(2-bromanyl-6-methyl-pyridin-4-yl)methyl]pyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-methyl 4-[(2-bromanyl-6-methyl-pyridin-4-yl)methyl]pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-methyl 4-[(2-bromo-6-methyl-4-pyridyl)methyl]pyrrolidine-1,2-dicarboxylate CAS Name: 4-[(2-bromo-6-methyl-4-pyridinyl)methyl]pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester IUPAC Name: 1-O-tert-butyl 2-O-methyl 4-[(2-bromo-6-methylpyridin-4-yl)methyl]pyrrolidine-1,2-dicarboxylate Traditional Name: 4-[(2-bromo-6-methyl-4-pyridyl)methyl]pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester Formula: C18H25BrN2O4 MolecularWeight: 413.3061

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=C1)CC2CC(N(C2)C(=O)OC(C)(C)C)C(=O)OC)Br

Isomeric SMILES

CC1=NC(=CC(=C1)CC2CC(N(C2)C(=O)OC(C)(C)C)C(=O)OC)Br

InChI

InChI=1S/C18H25BrN2O4/c1-11-6-12(9-15(19)20-11)7-13-8-14(16(22)24-5)21(10-13)17(23)25-18(2,3)4/h6,9,13-14H,7-8,10H2,1-5H3